1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one
TL;DR: 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one (CAS 174816-00-3) is a chemical compound with molecular formula C17H16N2OS and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one
Also Known As: 1-benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one, BAS 00432477, NCI60_018669, BIM-0020523.P001, 1-Benzyl-3-thiiranylmethyl-1,3-dihydro-benzoimidazol-2-one
| Molecular Formula | C17H16N2OS |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 48.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.09833 |
| Heavy Atoms | 21 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 174816-00-3 |
|---|---|
| SMILES | C1C(S1)CN2C3=CC=CC=C3N(C2=O)CC4=CC=CC=C4 |
| InChIKey | RKSFZQLJGXVSBG-UHFFFAOYSA-N |
Product Overview
1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one (CAS 174816-00-3), with molecular formula C17H16N2OS and molecular weight 296.10 g/mol. IUPAC: 1-benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one.
Chemical Property Profile of 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one
Property Insights of 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one. With a topological polar surface area (TPSA) of 48.9 Ų, 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one?
The CAS number of 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one is 174816-00-3.
What is the molecular formula of 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one?
The molecular formula of 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one is C17H16N2OS.
What is the molecular weight of 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one?
The molecular weight of 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one is 296.10 g/mol.
Where can I buy 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one?
You can request a quote for 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-3-(thiiran-2-ylmethyl)benzimidazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.